Geometry & MOs

Info

ID:	264774
PubChem CID:	103489680
Reduced:	O3C10H22 (1)
Stoich.:	A3B10C22 (1)
Weight, g/mol:	228.183778
ΔH_f, kcal/mol:	-171.28
Dipole, Da:	3.02
IP(EA), eV:	-9.8(1.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(1-ethoxypropan-2-yloxy)-2-(propylamino)butanenitrile

Drug info:

PubChemData

Smile

CCOCC(C)OC(C)CC(C)O

DOS

IR

Vibrations